SCHEMBL4764875

SCHEMBL4764875

Cn1cnc(-c2ccccc2)c1C=O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.52
FLT1 P17948 4/20 0.52
TEK Q02763 4/20 0.52
NSD3 Q9BZ95 1/20 0.50
NTRK1 P04629 1/20 0.42
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.40
PTGS2 P35354 3/20 0.39
ADK P55263 1/20 0.38
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NSD2 O96028 1/20 0.38
LDLR P01130 1/20 0.36
PCSK9 Q8NBP7 1/20 0.36
HPGDS O60760 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15013190 0.83 PTGS2 (0.42) KDRFLT1TEKNSD3NTRK1
SCHEMBL12457300 0.78 NSD2 (0.40) KDRFLT1TEKNSD3LMNA
SCHEMBL461609 0.74 PDE10A (0.45) LMNAALDH1A1KDM4EGAAHPGD
SCHEMBL4767226 0.74 KDR (0.59) KDRFLT1TEKNSD3NTRK1
SCHEMBL4767231 0.74 KDR (0.59) KDRFLT1TEKNSD3NTRK1
SCHEMBL4774618 0.73 TEK (0.56) KDRFLT1TEKLMNATSHR
SCHEMBL1009513 0.73 NSD3 (0.83) KDRFLT1TEKNSD3LMNA
SCHEMBL19159715 0.73 NSD3 (0.56) KDRFLT1TEKNSD3NTRK1
SCHEMBL4774516 0.72 TEK (0.67) KDRFLT1TEKNSD3
SCHEMBL4774512 0.72 TEK (0.67) KDRFLT1TEKNSD3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114634665-B Vinyl polymer/modified polyhydroxy polymer composites and uses thereof 国家电投集团氢能科技发展有限公司 2024-10-22 CN disclosed
CN-114634665-A Vinyl polymer/modified polyhydroxy polymer composites and uses thereof 国家电投集团氢能科技发展有限公司 2022-06-17 CN disclosed
US-7427616-B2 Condensed pyridines and pyrimidines with tie2 (TEK) activity ASTRAZENECA AB (SE) 2008-09-23 US disclosed
EP-1575963-B1 ANTI-ANGIOGENETIC THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2008-05-07 EP disclosed
EP-1537112-B1 CONDENSED PYRIDINES AND PYRIMIDINES WITH TIE2 (TEK) ACTIVITY ASTRAZENECA AB (SE) 2006-04-19 EP disclosed
US-20060069109-A1 Therapeutic agents ASTRAZENECA AB (SE) 2006-03-30 US disclosed
CN-1751052-A Therapeutic agents ASTRAZENECA AB (SE) 2006-03-22 CN disclosed
US-20050256140-A1 Condensed pyridines and pyrimidines with tie2 (tek) activity ASTRAZENECA AB (SE) 2005-11-17 US disclosed
CN-1688579-A Condensed pyridines and pyrimidines with TIE2 (TEK) activity ASTRAZENECA AB (SE) 2005-10-26 CN disclosed
EP-1575963-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2005-09-21 EP disclosed
EP-1537112-A1 CONDENSED PYRIDINES AND PYRIMIDINES WITH TIE2 (TEK) ACTIVITY Astrazeneca AB (SE) 2005-06-08 EP disclosed
WO-2004058776-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2004-07-15 WO disclosed
WO-2004013141-A1 CONDENSED PYRIDINES AND PYRIMIDINES WITH TIE2 (TEK) ACTIVITY ASTRAZENECA AB (SE) 2004-02-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060069109-A1 Therapeutic agents TIE1, TEK, KDR KDR 3/4885FLT1 4/4885TEK 2/4885
US-20050256140-A1 Condensed pyridines and pyrimidines with tie2 (tek) activity TIE1, TEK, KDR KDR 3/4885FLT1 6/4885TEK 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.